2-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]ethanenitrile

Systemtic Name: 2-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]ethanenitrile Openeye Name: 2-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]acetonitrile CAS Name: 2-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]acetonitrile IUPAC Name: 2-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]acetonitrile Traditional Name: 2-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]acetonitrile Formula: C19H17N3O2 MolecularWeight: 319.35718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2CC#N)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2CC#N)C3=CC=CC=C3)OC

InChI

InChI=1S/C19H17N3O2/c1-23-17-9-8-14(12-18(17)24-2)19-15(10-11-20)13-22(21-19)16-6-4-3-5-7-16/h3-9,12-13H,10H2,1-2H3